N,1-dibutyl-2-(2-oxidanylidenepropylsulfanyl)benzimidazole-5-sulfonamide

Systemtic Name: N,1-dibutyl-2-(2-oxidanylidenepropylsulfanyl)benzimidazole-5-sulfonamide Openeye Name: 2-acetonylsulfanyl-N,1-dibutyl-benzimidazole-5-sulfonamide CAS Name: N,1-dibutyl-2-(2-oxopropylthio)-5-benzimidazolesulfonamide IUPAC Name: N,1-dibutyl-2-(2-oxopropylsulfanyl)benzimidazole-5-sulfonamide Traditional Name: 2-(acetonylthio)-N,1-dibutyl-benzimidazole-5-sulfonamide Formula: C18H27N3O3S2 MolecularWeight: 397.55528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)C)CCCC

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)C)CCCC

InChI

InChI=1S/C18H27N3O3S2/c1-4-6-10-19-26(23,24)15-8-9-17-16(12-15)20-18(25-13-14(3)22)21(17)11-7-5-2/h8-9,12,19H,4-7,10-11,13H2,1-3H3